Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 2/20 | 0.49 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.49 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.45 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL24863725 | 0.85 | ROCK2 (0.51) | ROCK2ROCK1KLKB1 | |
| SCHEMBL15881663 | 0.77 | ALDH1A1 (0.55) | — | |
| SCHEMBL15881635 | 0.77 | ALDH1A1 (0.55) | — | |
| SCHEMBL23052072 | 0.76 | CYP1A2 (0.50) | — | |
| SCHEMBL15983143 | 0.76 | ROCK2 (0.42) | ROCK2ROCK1KLKB1 | |
| SCHEMBL18901136 | 0.74 | ROCK2 (0.41) | ROCK2ROCK1KLKB1 | |
| SCHEMBL26217825 | 0.73 | CYP1A2 (0.41) | ROCK2ROCK1KLKB1 | |
| SCHEMBL14228558 | 0.73 | HTR2A (0.39) | ROCK2ROCK1 | |
| SCHEMBL4395979 | 0.73 | GAA (0.46) | ROCK2ROCK1 | |
| SCHEMBL29835991 | 0.73 | GAA (0.46) | ROCK2ROCK1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4116299-A1 | HETEROCYCLIC COMPOUND | Medshine Discovery Inc. (CN) | 2023-01-11 | — | — | EP | disclosed |